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149065-76-9

149065-76-9 | Oxazole, 4,5-dihydro-4-(1-methylethyl)-2-(2-thienyl)-, (4S)-

CAS No: 149065-76-9 Catalog No: AG001LDG MDL No:

Product Description

Catalog Number:
AG001LDG
Chemical Name:
Oxazole, 4,5-dihydro-4-(1-methylethyl)-2-(2-thienyl)-, (4S)-
CAS Number:
149065-76-9
Molecular Formula:
C10H13NOS
Molecular Weight:
195.2813
IUPAC Name:
(4S)-4-propan-2-yl-2-thiophen-2-yl-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C10H13NOS/c1-7(2)8-6-12-10(11-8)9-4-3-5-13-9/h3-5,7-8H,6H2,1-2H3/t8-/m1/s1
InChI Key:
HRYFVDIOBOYZCJ-MRVPVSSYSA-N
SMILES:
CC([C@H]1COC(=N1)c1cccs1)C

Properties

Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
195.072g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.28g/mol
Monoisotopic Mass:
195.072g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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